1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine

C11H20ClNOSSn — CID 173288245

IUPAC1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine
SMILESCCCO[SnH](Cl)CCc1ccsc1C(C)N
InChIInChI=1S/C8H12NS.C3H7O.ClH.Sn.H/c1-3-7-4-5-10-8(7)6(2)9;1-2-3-4;;;/h4-6H,1,3,9H2,2H3;2-3H2,1H3;1H;;/q;-1;;+2;/p-1
InChIKeySLPSMHRPKFULKE-UHFFFAOYSA-M
MW368.52 g/mol
LogP3.20
Rot. Bonds7

About 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine

1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine (PubChem CID 173288245) has the molecular formula C11H20ClNOSSn and a molecular weight of 368.52 g/mol. Its IUPAC name is 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine.

Molecular Properties

Compound Name1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine
PubChem CID173288245
Molecular FormulaC11H20ClNOSSn
Molecular Weight368.52 g/mol
Exact Mass369.00
IUPAC Name1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine
SMILESCCCO[SnH](Cl)CCc1ccsc1C(C)N
InChIInChI=1S/C8H12NS.C3H7O.ClH.Sn.H/c1-3-7-4-5-10-8(7)6(2)9;1-2-3-4;;;/h4-6H,1,3,9H2,2H3;2-3H2,1H3;1H;;/q;-1;;+2;/p-1
InChIKeySLPSMHRPKFULKE-UHFFFAOYSA-M
XLogP3.20
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.52
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine?
The IUPAC name of 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine (CID 173288245) is 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine.
What is the SMILES notation for 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine?
The canonical SMILES for 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine is CCCO[SnH](Cl)CCc1ccsc1C(C)N.
What is the InChIKey of 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine?
The InChIKey is SLPSMHRPKFULKE-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H12NS.C3H7O.ClH.Sn.H/c1-3-7-4-5-10-8(7)6(2)9;1-2-3-4;;;/h4-6H,1,3,9H2,2H3;2-3H2,1H3;1H;;/q;-1;;+2;/p-1.
What are the key properties of 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine?
1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine has a molecular weight of 368.52 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-[chloro(propoxy)stannyl]ethyl]thiophen-2-yl]ethanamine is sourced from PubChem (CID 173288245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).